Structure

Creatine

CAS
57-00-1
Catalog Number
ACM57001
Category
Other Products
Molecular Weight
131.13
Molecular Formula
C4H9N3O2

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Specification

Synonyms
N-Methyl-N-amidinoglycine
IUPAC Name
2-[Carbamimidoyl(methyl)amino]acetic acid
Canonical SMILES
CN(CC(=O)O)C(=N)N
InChI
InChI=1S/C4H9N3O2/c1-7(4(5)6)2-3(8)9/h2H2,1H3,(H3,5,6)(H,8,9)
InChI Key
CVSVTCORWBXHQV-UHFFFAOYSA-N
Boiling Point
242.43 °C
Melting Point
-295 °C
Flash Point
118.1 °C
Density
1.33 g/cm³
Solubility
Soluble in water
Appearance
Solid
Storage
Keep in dark place, inert atmosphere, room temperature
Active Content
95%
Complexity
134
EC Number
200-306-6
Exact Mass
131.069476538
Hazard Statements
Xi:Irritant
H-Bond Acceptor
5
H-Bond Donor
3
Monoisotopic Mass
131.069476538
Physical State
Solid
pKa
2.63(at 25 °C)
Refractive Index
1.5700
Safety Description
S26-S36
Solubility In Water
Soluble
Stability
Stable in range pH 6-8; to light and heat.
Topological Polar Surface Area
90.4 Ų
WGK Germany
3
July 19, 2023


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After purchasing creatine's specifications incorrectly, the request for a replacement is very responsive.

What is the EC number for creatine?

241-730-1

What is the InchI Key of creatine?

CLOMYZFHNHFSIQ-UHFFFAOYSA-N

What is the IUPAC name of creatine?

2-(3-chloro-2-methylanilino)pyridine-3-carboxylic acid

What is the molecular formula for creatine?

C13H11ClN2O2

What is the molecular weight of creatine?

262.69

What is the number of covalent bonding units of creatine?

1

What is the number of heavy atoms in creatine?

18

What is the RTECS number for creatine?

QT0960000

What is the SMILES of creatine?

CC1=C(C=CC=C1Cl)NC2=C(C=CC=N2)C(=O)O

What is the XLogP3-AA of creatine?

3.8

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